3-(2-{2-[2-(4-methyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-{2-[2-(4-methyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
3-(2-{2-[2-(4-methyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | SD73-0074 |
| Compound Name: | 3-(2-{2-[2-(4-methyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 355.39 |
| Molecular Formula: | C18 H21 N5 O3 |
| Smiles: | Cn1cnnc1CCC1CCCN1C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6542 |
| logD: | 0.6542 |
| logSw: | -1.6618 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.36 |
| InChI Key: | FANKMFFTCUZBPG-CYBMUJFWSA-N |